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Home > Quinoline > 1187163-96-7
1187163-96-7 | 3-(2,5-Dimethoxybenzoyl)quinoline
CAS No: 1187163-96-7 Catalog No: AG01FEBE MDL No:
Product Description
Catalog Number:
AG01FEBE
Chemical Name:
3-(2,5-Dimethoxybenzoyl)quinoline
CAS Number:
1187163-96-7
Molecular Formula:
C18H15NO3
Molecular Weight:
293.3166
IUPAC Name:
(2,5-dimethoxyphenyl)-quinolin-3-ylmethanone
InChI:
InChI=1S/C18H15NO3/c1-21-14-7-8-17(22-2)15(10-14)18(20)13-9-12-5-3-4-6-16(12)19-11-13/h3-11H,1-2H3
InChI Key:
YJACRGRCUZQIHC-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(=O)c1cnc2c(c1)cccc2)OC
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.105g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.322g/mol
Monoisotopic Mass:
293.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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